Molecule

ID:104220

General Information
Structure
MolImage
Molecular Formula
C₃H₇NO₂
Molecular Mass
89.09318
Exact Mass
89.04767847
Charge
0
InChI
InChI=1S/C3H7NO2/c1-2(5)3(4)6/h2,5H,1H3,(H2,4,6)
InChIKey
SXQFCVDSOLSHOQ-UHFFFAOYSA-N
Canonic Smiles
CC(C(=O)N)O
Isomeric Smiles
CC(O)C(=O)N
Calculated Properties
JChem
LogD (pH = 7.4)
-1.28
LogD (pH = 5.5)
-1.28
Log P
-1.28
Rotatable Bonds
1
H Donor
2
H Acceptors
2
Lipinski's Rule of Five
true
Acid pKa
13.49
Polar Surface Area
63.32
Polarizability
8.47
Molar Refractivity
20.66
LOG S
0.28
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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